SCHEMBL10032270

SCHEMBL10032270

Cc1ccc(-c2ccc3ccc4ccc(-c5ccc6ccc(-c7ccc8ccc9ccc(-c%10ccc(C)cc%10)nc9c8n7)cc6c5)nc4c3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.46
CYP1A2 P05177 2/20 0.43
CYP2A6 P11509 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.42
ALDH1A1 P00352 5/20 0.41
HPGD P15428 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
KDM4E B2RXH2 4/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ENPP3 O14638 1/20 0.39
ENPP1 P22413 1/20 0.39
GAK O14976 1/20 0.39
RAB9A P51151 3/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8477633 0.90 SMN1; SMN2 (0.48) CYP1A2SMN1; SMN2ALDH1A1HPGDCYP3A4
SCHEMBL10032244 0.90 SMN1; SMN2 (0.48) CYP1A2SMN1; SMN2ALDH1A1HPGDCYP3A4
SCHEMBL10032480 0.88 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1HPGDMEN1KMT2A
SCHEMBL10032338 0.88 ENPP3 (0.48) SMN1; SMN2ALDH1A1HPGDMEN1KMT2A
SCHEMBL10032365 0.87 MEN1 (0.47) CTRCCYP1A2SMN1; SMN2ALDH1A1HPGD
SCHEMBL10032440 0.85 MEN1 (0.46) CTRCCYP1A2SMN1; SMN2ALDH1A1HPGD
SCHEMBL10032337 0.85 CCR1 (0.58) CYP1A2RAB9ACCR1CCR5
SCHEMBL10032325 0.84 CTRC (0.38) CTRCCYP1A2CYP2A6SMN1; SMN2ALDH1A1
SCHEMBL10032376 0.84 CYP2A6 (0.43) CTRCCYP1A2CYP2A6SMN1; SMN2ALDH1A1
SCHEMBL10032269 0.82 CYP1A1 (0.53) CTRCCYP1A2SMN1; SMN2ALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed